3-Chlorofluocinolone Acetonide 21-Acetate
[CAS# 99339-99-8]

Identification

• Name: 3-Chlorofluocinolone Acetonide 21-Acetate
• Synonyms: 3-Chlorofluocinolone Acetonide 21-Acetate; 3-Cl-Fa-Ac; Pregna-1,3,5-Trien-20-One, 21-(Acetyloxy)-3-Chloro-6,9-Difluoro-11-Hydroxy-16,17-((1-Methylethylidene)Bis(Oxy))-, (11Beta,16Alpha)-
• Molecular Formula: C₂₆H₃₁ClF₂O₆
• Molecular Weight: 512.98
• CAS Registry Number: 99339-99-8
• SMILES: [C@]12(OC(O[C@@H]1C[C@@H]4[C@@]2(C[C@@H]([C@@]5([C@]3(C=CC(=CC3=C(C[C@@H]45)F)Cl)C)F)O)C)(C)C)C(=O)COC(C)=O
• InChI: 1S/C26H31ClF2O6/c1-13(30)33-12-20(32)26-21(34-22(2,3)35-26)10-15-16-9-18(28)17-8-14(27)6-7-23(17,4)25(16,29)19(31)11-24(15,26)5/h6-8,15-16,19,21,31H,9-12H2,1-5H3/t15-,16-,19-,21+,23-,24-,25-,26+/m0/s1
• InChIKey: ODRAMFDLVCCUCI-YRCSZXIRSA-N

Properties

• Density: 1.368g/cm³ (Cal.)
• Boiling point: 582.398°C at 760 mmHg (Cal.)
• Flash point: 306.024°C (Cal.)